On Target SRC_HUMAN 0.25465837/CHEMBL3109399
For the given ligand Genipin, we have found in our database that, being scored 0.25465837, the most similar ligand is CHEMBL3109399. Check out the elaboration below.
| Genipin (Given Ligand) | CHEMBL3109399 (Similar Ligand) |
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| COC(=O)/C1=C/O[C@@H](O)[C@@H]2/C(CO)=C\C[C@H]12 | CC1=CCC[C@H]2[C@](C)(CC3=C(O)C(=O)C=C(NCCc4ccccc4)C3=O)[C@@H](C)CC[C@@]12C |
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| 00010000 81000000 00000801 10010101 00290001 00000001 00020000 08001402 01000000 00508048 08000200 40409010 8402802a 02800000 02000405 01280008 00820004 00000000 10446010 00008a01 00000000 00000a00 0100a000 00000010 00201000 80200400 00405000 a0000000 00004240 00000000 0e00a000 00000010 | 00410002 09000001 00100900 00090600 00000000 00080004 000803a0 22000402 01000480 001808c8 08200600 4101f000 8602800a 00000000 80000404 00080448 00010000 02000060 02272000 00020201 00000001 98200290 01008000 81500810 04a00000 80000000 00404040 90040500 04104000 00060402 2c024000 40002600 |